SCHEMBL29935659

SCHEMBL29935659

O=Cc1cccc(-c2cc[nH]n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 1/20 0.49
▸ TRIM24 O15164 1/20 0.42
▸ TRIM33 Q9UPN9 1/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ AXL P30530 1/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ NPY5R Q15761 1/20 0.38
▸ UNG P13051 1/20 0.37
▸ DYRK1A Q13627 2/20 0.37
▸ DYRK2 Q92630 2/20 0.37
▸ DYRK1B Q9Y463 2/20 0.37
▸ DYRK3 O43781 1/20 0.37
▸ CCNT1 O60563 1/20 0.37
▸ CDK9 P50750 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4081950 1.00 CDK8 (0.49) CDK8TRIM24TRIM33BRD4AXL
SCHEMBL1785182 0.85 DRD1 (0.47) CDK8TRIM24TRIM33AXLCA12
Valine SCHEMBL7594946 0.82 CDK8 (0.39) CDK8TRIM24TRIM33BRD4AXL
SCHEMBL5468496 0.81 IDO1 (0.37) CYP2A6
SCHEMBL7030925 0.78 DRD1 (0.39) BRD4ALDH1A1CYP2A6
SCHEMBL27753863 0.76 ALDH1A1 (0.40) CDK8TRIM24TRIM33AXLALDH1A1
SCHEMBL4564602 0.75 CDK8 (0.44) CDK8TRIM24TRIM33BRD4AXL
SCHEMBL346974 0.74 TRIM24 (0.64) CDK8TRIM24TRIM33BRD4AXL
SCHEMBL17900086 0.74 GP6 (0.46) MAOA
SCHEMBL29484275 0.74 GP6 (0.46) MAOA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 — — CN claimed
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 — — US disclosed
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 — — CN disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 — — US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 — — US disclosed
CN-111601807-B Exo-azaspiro inhibitors of MENIN-MLL interactions 詹森药业有限公司 2023-03-31 — — CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CDK8 2963/4885TRIM24 4058/4885TRIM33 4330/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH CDK8 4037/4885TRIM24 4302/4885TRIM33 4595/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP CDK8 2963/4885TRIM24 4058/4885TRIM33 4330/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP CDK8 2963/4885TRIM24 4058/4885TRIM33 4330/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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